5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine

C14H18N2O2 — CID 116831725

IUPAC5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine
SMILESCOc1cc(C(C)C)ccc1-c1oc(N)nc1C
InChIInChI=1S/C14H18N2O2/c1-8(2)10-5-6-11(12(7-10)17-4)13-9(3)16-14(15)18-13/h5-8H,1-4H3,(H2,15,16)
InChIKeyLDVGBRCDWRMRSQ-UHFFFAOYSA-N
MW246.31 g/mol
LogP3.36
Rot. Bonds3

About 5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine

5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine (PubChem CID 116831725) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine.

Molecular Properties

Compound Name5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine
PubChem CID116831725
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine
SMILESCOc1cc(C(C)C)ccc1-c1oc(N)nc1C
InChIInChI=1S/C14H18N2O2/c1-8(2)10-5-6-11(12(7-10)17-4)13-9(3)16-14(15)18-13/h5-8H,1-4H3,(H2,15,16)
InChIKeyLDVGBRCDWRMRSQ-UHFFFAOYSA-N
XLogP3.36
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-thiazol-5-amine
CID 116864511
4-(2-methoxy-4-propan-2-ylphenyl)-6-methylpyrimidin-2-amine
CID 82300071
4-(2-methoxy-4-propan-2-ylphenyl)imidazole-1,2-diamine
CID 82295339
[5-(2-methoxy-4-propan-2-ylphenyl)-1,2-oxazol-4-yl]methanamine
CID 82295318
5-(2-methoxy-4-propan-2-ylphenyl)-6-methyl-2-N-pentan-3-ylpyrazine-2,3-diamine
CID 10020281
5-(2-methoxy-5-propan-2-ylphenyl)-2,6-dimethylpyrimidin-4-amine
CID 95474423
5-(2-methoxy-4-propan-2-ylphenyl)-1,3-dimethylpyrazole
CID 116856768
[5-(2-methoxy-4-propan-2-ylphenyl)-1H-imidazol-2-yl]methanol
CID 116878297
6-(2-methoxy-5-propan-2-ylphenyl)-3-methyl-1,2,4-triazin-5-amine
CID 116823436
4-methoxy-6-propan-2-ylazulene
CID 56627743
3-chloro-5-(2-methoxy-4-propan-2-ylphenyl)-1,2-thiazole
CID 67807977
6-(2-methoxy-4-propan-2-ylphenyl)-N-methylpyridazin-3-amine
CID 82483067

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine?
The IUPAC name of 5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine (CID 116831725) is 5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine.
What is the SMILES notation for 5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine?
The canonical SMILES for 5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine is COc1cc(C(C)C)ccc1-c1oc(N)nc1C.
What is the InChIKey of 5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine?
The InChIKey is LDVGBRCDWRMRSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-8(2)10-5-6-11(12(7-10)17-4)13-9(3)16-14(15)18-13/h5-8H,1-4H3,(H2,15,16).
What are the key properties of 5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine?
5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine has a molecular weight of 246.31 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-oxazol-2-amine is sourced from PubChem (CID 116831725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).